2-[4-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-4-oxidanylidene-butyl]-1H-quinazolin-4-one

Systemtic Name: 2-[4-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-4-oxidanylidene-butyl]-1H-quinazolin-4-one Openeye Name: 2-[4-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazin-1-yl]-4-oxo-butyl]-1H-quinazolin-4-one CAS Name: 2-[4-[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1-piperazinyl]-4-oxobutyl]-1H-quinazolin-4-one IUPAC Name: 2-[4-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperazin-1-yl]-4-oxobutyl]-1H-quinazolin-4-one Traditional Name: 2-[4-[4-(3,5-dimethylisoxazol-4-yl)sulfonylpiperazino]-4-keto-butyl]-1H-quinazolin-4-one Formula: C21H25N5O5S MolecularWeight: 459.5187

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C21H25N5O5S/c1-14-20(15(2)31-24-14)32(29,30)26-12-10-25(11-13-26)19(27)9-5-8-18-22-17-7-4-3-6-16(17)21(28)23-18/h3-4,6-7H,5,8-13H2,1-2H3,(H,22,23,28)